SpectraBase Spectrum ID |
5J4HHz9hGbY |
Name |
17b-Hydroxy-androstano[2,3-d]isoxazole |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
17928 |
Lot Number |
0522281-3 |
Accessory |
DurasamplIR II |
CAS Registry Number |
80651-65-6 |
Copyright |
Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.219829176 u |
Formula |
C20H29NO2 |
InChI |
InChI=1S/C20H29NO2/c1-19-8-7-16-14(15(19)5-6-18(19)22)4-3-13-9-17-12(11-21-23-17)10-20(13,16)2/h11,13-16,18,22H,3-10H2,1-2H3/t13-,14-,15-,16-,18-,19-,20-/m0/s1 |
InChIKey |
FOCHADJYNFKGMY-YNZDMMAESA-N |
Instrument Name |
Bio-Rad FTS |
Molecular Weight |
315.457 g/mol |
Purity |
≥98% |
Resolution |
4 |
SMILES |
O[C@@]1([C@@]2([C@]([C@]3([C@@]([C@@]4([C@@](CC3)(CC=3ON=CC3C4)[H])C)(CC2)[H])[H])(CC1)[H])C)[H] |
Scan Speed (number) |
5 |
Source of Spectrum |
Forensic Spectral Research |
Synonyms |
(5α,17β)-androst-2-eno[2,3-d]isoxazol-17-ol |
Technique |
ATR-Neat |